N-cyclohexyl-3-[4-methoxy-3-(methylcarbamothioylsulfamoyl)phenyl]propanamide

Systemtic Name: N-cyclohexyl-3-[4-methoxy-3-(methylcarbamothioylsulfamoyl)phenyl]propanamide Openeye Name: N-cyclohexyl-3-[4-methoxy-3-(methylcarbamothioylsulfamoyl)phenyl]propanamide CAS Name: N-cyclohexyl-3-[4-methoxy-3-[[methylamino(sulfanylidene)methyl]sulfamoyl]phenyl]propanamide IUPAC Name: N-cyclohexyl-3-[4-methoxy-3-(methylcarbamothioylsulfamoyl)phenyl]propanamide Traditional Name: N-cyclohexyl-3-[4-methoxy-3-(methylthiocarbamoylsulfamoyl)phenyl]propionamide Formula: C18H27N3O4S2 MolecularWeight: 413.55468

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=S)NS(=O)(=O)C1=C(C=CC(=C1)CCC(=O)NC2CCCCC2)OC

Isomeric SMILES

CNC(=S)NS(=O)(=O)C1=C(C=CC(=C1)CCC(=O)NC2CCCCC2)OC

InChI

InChI=1S/C18H27N3O4S2/c1-19-18(26)21-27(23,24)16-12-13(8-10-15(16)25-2)9-11-17(22)20-14-6-4-3-5-7-14/h8,10,12,14H,3-7,9,11H2,1-2H3,(H,20,22)(H2,19,21,26)